Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.60 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.60 |
| ▸ | GAA | P10253 | 2/20 | 0.60 |
| ▸ | KMT2A | Q03164 | 7/20 | 0.55 |
| ▸ | MEN1 | O00255 | 5/20 | 0.55 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.54 |
| ▸ | RAB9A | P51151 | 3/20 | 0.53 |
| ▸ | LMNA | P02545 | 2/20 | 0.53 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.53 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.53 |
| ▸ | HTT | P42858 | 1/20 | 0.53 |
| ▸ | GLA | P06280 | 1/20 | 0.53 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.53 |
| ▸ | MAPT | P10636 | 2/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL20839484 | 0.81 | ABCG2 (0.68) | ALDH1A1SMN1; SMN2GAAKMT2AMEN1 | |
| SCHEMBL8711203 | 0.81 | RAB9A (0.74) | ALDH1A1SMN1; SMN2GAAKMT2AMEN1 | |
| SCHEMBL5224758 | 0.81 | MEN1 (0.67) | ALDH1A1KMT2AMEN1ABCG2LMNA | |
| SCHEMBL11453866 | 0.80 | KMT2A (0.64) | ALDH1A1SMN1; SMN2GAAKMT2AMEN1 | |
| SCHEMBL29282077 | 0.79 | MEN1 (0.65) | ALDH1A1SMN1; SMN2GAAKMT2AMEN1 | |
| SCHEMBL20839774 | 0.77 | ALDH1A1 (0.60) | ALDH1A1SMN1; SMN2GAAKMT2AMEN1 | |
| SCHEMBL3059908 | 0.77 | SMN1; SMN2 (0.65) | ALDH1A1SMN1; SMN2GAAKMT2AMEN1 | |
| SCHEMBL20839940 | 0.76 | NR1H4 (0.59) | ALDH1A1SMN1; SMN2KMT2AMEN1RAB9A | |
| SCHEMBL13088896 | 0.76 | NPC1 (0.49) | ALDH1A1SMN1; SMN2GAAKMT2AMEN1 | |
| SCHEMBL3067704 | 0.75 | ALDH1A1 (0.50) | ALDH1A1SMN1; SMN2KMT2ARAB9ALMNA |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2019057969-A1 | DUAL AGONISTS OF FXR AND PPARδ AND THEIR USES | Johann Wolfgang Goethe-Universität (DE) | 2019-03-28 | — | — | WO | disclosed |